Analyte Name

Resveratrol-2',3',5',6'-d4 3-O-beta-D-Glucuronide

Molecular Formula

C21 D4 H18 O9

Molecular Weight

422.419

Accurate Mass

422.151

SMILES

[2H]c1c([2H])c(\C=C\c2cc(O)cc(O[C@@H]3O[C@H](CC(=O)O)[C@@H](O)[C@H](O)[C@H]3O)c2)c([2H])c([2H])c1O

InChI

InChI=1S/C21H22O9/c22-13-5-3-11(4-6-13)1-2-12-7-14(23)9-15(8-12)29-21-20(28)19(27)18(26)16(30-21)10-17(24)25/h1-9,16,18-23,26-28H,10H2,(H,24,25)/b2-1+/t16-,18-,19+,20-,21-/m1/s1/i3D,4D,5D,6D

IUPAC

2-[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-hydroxy-5-[(E)-2-(2,3,5,6-tetradeuterio-4-hydroxyphenyl)ethenyl]phenoxy]oxan-2-yl]acetic acid

Unlabelled CAS Number

387372-17-0

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat